SpectraBase Spectrum ID |
FMFOmr5e9uT |
Name |
6-Butyl-1-(2,6-dichloro-4-(trifluoromethyl)phenyl)-1H-pyrazolo[3,4-b]pyridine-3-carbonitrile |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C18H13Cl2F3N4 |
InChI |
InChI=1S/C18H13Cl2F3N4/c1-2-3-4-11-5-6-12-15(9-24)26-27(17(12)25-11)16-13(19)7-10(8-14(16)20)18(21,22)23/h5-8H,2-4H2,1H3 |
InChIKey |
LJDJWIZLPUCGSY-UHFFFAOYSA-N |
Instrument Name |
MicroMass GCT CA 055 |
Ionization Type |
EI |
Literature Reference DOI |
10.3998/ark.5550190.0010.224 |
Molecular Weight |
413.231 g/mol |
Reported Formula |
C18H13F3Cl2N4 |
SMILES |
C(CCC)c1ccc2c(n1)[n](nc2C#N)-c1c(cc(cc1Cl)C(F)(F)F)Cl |
SPLASH |
splash10-00di-0009000000-3594b041070985e916bf |
Source of Spectrum |
ARK-2009-266-23 |
Wiley ID |
1866627 |